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2-Chloranyl-6-(1-ethoxyethenyl)-9-(phenylmethyl)purine
SpectraBase Compound ID Dk146X4Mhs8
InChI InChI=1S/C16H15ClN4O/c1-3-22-11(2)13-14-15(20-16(17)19-13)21(10-18-14)9-12-7-5-4-6-8-12/h4-8,10H,2-3,9H2,1H3
InChIKey LQDDYZSKRRNPBA-UHFFFAOYSA-N
Mol Weight 314.78 g/mol
Molecular Formula C16H15ClN4O
Exact Mass 314.093439 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8KczsDUBUvF
Name 2-Chloranyl-6-(1-ethoxyethenyl)-9-(phenylmethyl)purine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15ClN4O
InChI InChI=1S/C16H15ClN4O/c1-3-22-11(2)13-14-15(20-16(17)19-13)21(10-18-14)9-12-7-5-4-6-8-12/h4-8,10H,2-3,9H2,1H3
InChIKey LQDDYZSKRRNPBA-UHFFFAOYSA-N
Molecular Weight 314.776 g/mol
SMILES c12c([n](Cc3ccccc3)cn1)nc(nc2C(=C)OCC)Cl
SPLASH splash10-006x-9081000000-dec81ab956aa78e7cf56
Source of Spectrum F-52-5632-3
Synonyms 2-Chloro-6-(1-ethoxyethenyl)-9-(phenylmethyl)purine 9-Benzyl-2-chloro-6-(1-ethoxyethenyl)purine 9-Benzyl-2-chloro-6-(1-ethoxyvinyl)purine
Wiley ID 796285